[(2S)-4-[4-(benzotriazol-1-ylmethyl)phenyl]carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [(2S)-4-[4-(benzotriazol-1-ylmethyl)phenyl]carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone Openeye Name: [(2S)-4-[4-(benzotriazol-1-ylmethyl)benzoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidyl)methanone CAS Name: [(2S)-4-[[4-(1-benzotriazolylmethyl)phenyl]-oxomethyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidinyl)methanone IUPAC Name: [(2S)-4-[4-(benzotriazol-1-ylmethyl)benzoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-ylmethanone Traditional Name: [(2S)-4-[4-(benzotriazol-1-ylmethyl)benzoyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidino-methanone Formula: C28H27N5O3 MolecularWeight: 481.54568

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CN(C3=CC=CC=C3O2)C(=O)C4=CC=C(C=C4)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H]2CN(C3=CC=CC=C3O2)C(=O)C4=CC=C(C=C4)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C28H27N5O3/c34-27(21-14-12-20(13-15-21)18-33-23-9-3-2-8-22(23)29-30-33)32-19-26(28(35)31-16-6-1-7-17-31)36-25-11-5-4-10-24(25)32/h2-5,8-15,26H,1,6-7,16-19H2/t26-/m0/s1